Known targets — ChEMBL curated mechanism
CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | CXCR5 | P32302 | 1/20 | 0.41 |
| ▸ | APLNR | P35414 | 1/20 | 0.41 |
| ▸ | CCR6 | P51684 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | ESPL1 | Q14674 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | MMP14 | P50281 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL4614640 | 0.90 | ESPL1 (0.43) | ACHEHSD17B10KMT2AHSP90AA1RAB9A | |
| SCHEMBL4615179 | 0.88 | ESPL1 (0.47) | ACHEHSD17B10KMT2AESPL1CYP3A4 | |
| Sulfuric Acid SCHEMBL4614646 | 0.87 | MAPT (0.42) | ACHEHSD17B10ESPL1CYP3A4ALDH1A1 | |
| Bromide SCHEMBL4614053 | 0.87 | ESPL1 (0.46) | ACHEHSD17B10KMT2AESPL1CYP3A4 | |
| Hydrochloric Acid SCHEMBL4614659 | 0.87 | ESPL1 (0.49) | ACHEHSD17B10KMT2ARAB9AESPL1 | |
| SCHEMBL5462937 | 0.85 | LMNA (0.41) | KMT2ACYP3A4CYP2C19ALDH1A1LMNA | |
| SCHEMBL7740549 | 0.84 | KMT2A (0.56) | ACHEHSD17B10KMT2AHSP90AA1RAB9A | |
| SCHEMBL4615093 | 0.83 | ESPL1 (0.43) | ACHEHSD17B10KMT2AESPL1CYP3A4 | |
| SCHEMBL7738172 | 0.82 | KMT2A (0.45) | ACHEHSD17B10KMT2AHSP90AA1RAB9A | |
| SCHEMBL28339818 | 0.82 | LMNA (0.37) | ACHEKMT2ABCHECYP1A2CYP3A4 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6413607-B1 | Cyanine dyes | KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) | 2002-07-02 | — | — | US | disclosed |
| EP-1088857-A1 | CYANINE DYE | Kabushiki Kaisha Hayashibara Seibutsu Kagaku Kenkyujo (JP) | 2001-04-04 | — | — | EP | disclosed |
| US-RE29168-E | HEAT SENSITIVE, ANTIHALATION LAYER | EASTMAN KODAK COMPANY (US) | 1977-04-05 | — | — | US | disclosed |